Geometry & MOs

Info

ID:	343768
PubChem CID:	127266944
Reduced:	Cl2N2O3C14H18 (1)
Stoich.:	A2B2C3D14E18 (1)
Weight, g/mol:	346.085098
ΔH_f, kcal/mol:	-124.72
Dipole, Da:	3.7
IP(EA), eV:	-9.2(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dichlorophenyl)-3-[4-hydroxy-2-(hydroxymethyl)-2-methylpyrrolidin-1-yl]propanamide

Drug info:

PubChemData

Smile

COC1CN(CCO1)CCC(=O)NC2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations